%chk=000121305.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121305

0 1
 O   0.7485000      0.3981000      0.1830000    
 N   -3.894300      -1.172200      0.4311000    
 N   -2.010800     -3.6200002E-02 -0.3240000    
 N   -4.171300      0.9840000     -0.2203000    
 C   -5.297200      -1.003600      0.6576000    
 C   -1.312700       1.113700     -0.8212000    
 C   -3.347200     -2.3200000E-02 -5.6600001E-02
 C   -5.496200      0.4541000      0.2234000    
 C   0.1502000      0.7746000      -1.050900    
 C    2.077200      6.4999998E-02  0.1488000    
 C    3.042100       1.049500      0.3405000    
 C    2.452900      -1.255900     -7.8000002E-02
 C    4.394600      0.7104000      0.3048000    
 C    3.805500      -1.594900     -0.1136000    
 C    4.776300     -0.6117000      7.7799998E-02
 C    2.653600       2.470700      0.5841000    
 C    1.428700      -2.322400     -0.2864000    
 H   -5.553700      -1.147800       1.711000    
 H   -5.887500      -1.689800      4.3299999E-02
 H   -1.387700       1.926200     -8.9299999E-02
 H   -1.760200       1.453100      -1.761800    
 H   -6.211500      0.5229000     -0.6030000    
 H   -5.872100       1.062300       1.052900    
 H   0.6629000       1.651300      -1.462600    
 H   0.2374000     -4.4000000E-02  -1.775200    
 H   -3.395500      -2.034600      0.6113000    
 H   -1.479200     -0.8836000     -0.1470000    
 H    5.162500       1.465700      0.4497000    
 H    4.118700      -2.620200     -0.2918000    
 H    5.829400     -0.8756000      4.8799999E-02
 H    2.415700       2.966600     -0.3620000    
 H    3.464300       3.028600       1.065700    
 H    1.788200       2.536800       1.252000    
 H    1.851800      -3.320000     -0.1248000    
 H   0.5989000      -2.215800      0.4201000    
 H    1.039400      -2.282400      -1.308200    


%chk=000121305-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121305

0 1
O 0.810999 0.574462 0.414557
N -3.857486 -1.256338 0.650506
N -1.937836 0.110697 0.137090
N -4.174418 0.787904 -0.414046
C -5.298753 -1.298317 0.293651
C -1.343859 1.371391 -0.321845
C -3.311100 -0.070846 0.100239
C -5.525781 0.161718 -0.263670
C 0.097187 1.136888 -0.765010
C 2.139574 0.123355 0.155502
C 3.211045 1.056257 0.160804
C 2.343818 -1.271487 -0.030764
C 4.522374 0.557764 -0.045549
C 3.668859 -1.726129 -0.238310
C 4.752446 -0.819406 -0.251346
C 2.964481 2.534661 0.400175
C 1.176672 -2.239894 0.024046
H -5.928933 -1.513223 1.174586
H -5.501101 -2.067620 -0.479714
H -1.365449 2.143870 0.475564
H -1.951989 1.751941 -1.160485
H -6.057537 0.153612 -1.232687
H -6.129924 0.762267 0.443271
H 0.571400 2.088925 -1.075112
H 0.146153 0.410979 -1.600487
H -3.311549 -2.119585 0.677931
H -1.383862 -0.410907 0.818549
H 5.365241 1.259469 -0.036825
H 3.848684 -2.797716 -0.385803
H 5.772132 -1.187062 -0.410761
H 2.788412 3.078094 -0.549044
H 3.837230 3.004348 0.885925
H 2.079047 2.687537 1.040485
H 1.494538 -3.254595 -0.271086
H 0.760843 -2.296558 1.048252
H 0.350142 -1.926754 -0.639390


